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Substance Name: 24-Ethylcholest-14-ene-3,16-diol
RN: 140147-34-8
InChIKey: UBIQQOLRFLRFBL-YUBQVYHLSA-N

Note

  • Isolated from the marine sponge Topsentia aurantiaca.

Molecular Formula

  • C29-H50-O2

Molecular Weight

  • 430.712
 
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Names and Synonyms

Name of Substance

  • 24-Ethylcholest-14-ene-3,16-diol

Synonyms

  • 24-Ethyl-5alpha-cholest-14-ene-3beta-16alpha-diol
  • 24R(-)-Ethylcholest-14-ene-3,16-diol
  • 24S(-)-Ethylcholest-14-ene-3,16-diol

Systematic Name

  • Stigmast-14-ene-3,16-diol, (3beta,5alpha,16alpha,24S)-

Registry Numbers

CAS Registry Number

  • 140147-34-8

System Generated Number

  • 0140147348

Structure Descriptors

InChI

1S/C29H50O2/c1-7-20(18(2)3)9-8-19(4)27-26(31)17-25-23-11-10-21-16-22(30)12-14-28(21,5)24(23)13-15-29(25,27)6/h17-24,26-27,30-31H,7-16H2,1-6H3/t19-,20+,21+,22+,23-,24+,26-,27+,28+,29+/m1/s1

InChIKey

UBIQQOLRFLRFBL-YUBQVYHLSA-N

Smiles

C1[C@@H](C[C@@H]2CC[C@H]3C4=C[C@H]([C@@H]([C@@H](CC[C@H](CC)C(C)C)C)[C@@]4(C)CC[C@H]3[C@@]2(C1)C)O)O